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(4S,5S)-2-[3-(N-Benzenesulfonylamino)-(1S)-1-phenylthiopropyl]-4-methyl-5-phenyl-1,3-oxazoline
SpectraBase Compound ID GFMDiEsW8ZW
InChI InChI=1S/C26H28N2O3S2/c1-20-25(21-12-6-3-7-13-21)31-26(27-20)24(32-22-14-8-4-9-15-22)18-19-28(2)33(29,30)23-16-10-5-11-17-23/h3-17,20,24-25H,18-19H2,1-2H3/t20-,24-,25+/m0/s1
InChIKey CYCCRSYMMMBBET-KSNOWIBYSA-N
Mol Weight 480.64 g/mol
Molecular Formula C26H28N2O3S2
Exact Mass 480.154135 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EtoLbZMnjZ8
Name (4S,5S)-2-[3-(N-Benzenesulfonylamino)-(1S)-1-phenylthiopropyl]-4-methyl-5-phenyl-1,3-oxazoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H28N2O3S2
InChI InChI=1S/C26H28N2O3S2/c1-20-25(21-12-6-3-7-13-21)31-26(27-20)24(32-22-14-8-4-9-15-22)18-19-28(2)33(29,30)23-16-10-5-11-17-23/h3-17,20,24-25H,18-19H2,1-2H3/t20-,24-,25+/m0/s1
InChIKey CYCCRSYMMMBBET-KSNOWIBYSA-N
Molecular Weight 480.641 g/mol
SMILES C(N(S(=O)(=O)c1ccccc1)C)C[C@@](C1=N[C@@](C)([C@@](O1)(c1ccccc1)[H])[H])(Sc1ccccc1)[H]
SPLASH splash10-002f-9600000000-30754bfc0a4130f85e7f
Source of Spectrum QC-8-2440-5g
Wiley ID 870038